Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | GALR3 | O60755 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7006751 | 1.00 | TSHR (0.34) | TSHRCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL29275508 | 0.89 | GALR3 (0.37) | GALR3PDE4DALDH1A1CTSK | |
| SCHEMBL28655932 | 0.88 | TSHR (0.33) | TSHRCHRM1GALR3CHRM2CHRM4 | |
| SCHEMBL11516139 | 0.87 | GALR3 (0.41) | GALR3PDE4DMAPT | |
| SCHEMBL11516146 | 0.87 | GALR3 (0.41) | GALR3PDE4DMAPT | |
| SCHEMBL4258145 | 0.83 | TSHR (0.37) | TSHRCHRM1TDP1GALR3CHRM2 | |
| SCHEMBL4258148 | 0.83 | TSHR (0.37) | TSHRCHRM1TDP1GALR3CHRM2 | |
| SCHEMBL31534046 | 0.83 | TSHR (0.37) | TSHRCHRM1TDP1GALR3CHRM2 | |
| SCHEMBL14224898 | 0.82 | TSHR (0.33) | TSHRCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL11490193 | 0.79 | USP2 (0.40) | TSHRCYP3A4MAPTSMN1; SMN2ALDH1A1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1335918-A1 | NOVEL COMPOUNDS | AstraZeneca AB (SE) | 2003-08-20 | — | — | EP | disclosed |
| WO-2002038571-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2002-05-16 | — | — | WO | disclosed |